Search filters

List of works by Stefan Kuhn

A pilot study for fragment identification using 2D NMR and deep learning

scientific article published on 04 September 2021

Applying NMR compound identification using NMRfilter to match predicted to experimental data

scientific article published on 21 November 2020

Bioclipse 2: a scriptable integration platform for the life sciences ⬇️

scientific article

Bioclipse: an open source workbench for chemo- and bioinformatics ⬇️

scientific article published on 22 February 2007

Building blocks for automated elucidation of metabolites: machine learning methods for NMR prediction

scientific article

Chemical Markup, XML, and the World Wide Web. 7. CMLSpect, an XML Vocabulary for Spectral Data

peer-reviewed article

Computational metabolomics – a field at the boundaries of cheminformatics and bioinformatics

Easy Structural Dereplication of Natural Products by Means of Predicted Carbon‐13 Nuclear Magnetic Resonance Spectroscopy Data

scientific article published on 7 November 2022

Eine offene NMR-Datenbank

Erratum to: The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching

scientific article published on 20 September 2017

Modelling of DNA mismatch repair with a reversible process calculus

scientific article published in 2022

NMRShiftDB - Constructing a Free Chemical Information System with Open-Source Components

scientific article

NMRShiftDB – compound identification and structure elucidation support through a free community-built web database

scientific article (publication date: October 2004)

NMReDATA, a standard to report the NMR assignment and parameters of organic compounds.

scientific article published on 14 April 2018

Progress on an open source computer-assisted structure elucidation suite (SENECA)

Recent Developments of the Chemistry Development Kit (CDK) - An Open-Source Java Library for Chemo- and Bioinformatics ⬇️

scientific article

The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching

scientific article

The Chemistry Development Kit (CDK): An Open-Source Java Library for Chemo- and Bioinformatics.

abstract about a scientific article published in 2003

The Chemistry Development Kit (CDK): an open-source Java library for Chemo- and Bioinformatics

scientific article from 2003

The Three Pillars of Natural Product Dereplication. Alkaloids from the Bulbs of Urceolina peruviana (C. Presl) J.F. Macbr. as a Preliminary Test Case

scientific article published on 27 January 2021

Twenty years of nmrshiftdb2: A case study of an open database for analytical chemistry

scientific article published on 19 December 2023

Paulina is supported by:

About Paulina

Help